(3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide

C120H142Cl2F4N24O13 — CID 161221366

About (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide

(3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide (PubChem CID 161221366) has the molecular formula C120H142Cl2F4N24O13 and a molecular weight of 2275.51 g/mol. Its IUPAC name is (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide.

Molecular Properties

• Compound Name: (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide
• PubChem CID: 161221366
• Molecular Formula: C120H142Cl2F4N24O13
• Molecular Weight: 2275.51 g/mol
• Exact Mass: 2273.05
• IUPAC Name: (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide
• SMILES: CC(C)(C)CC(=O)Nc1nc2ccc(C(C)(C)O)nc2n1C1CCC1.CC(C)(C)n1c(NC(=O)C[C@@](C)(O)c2ccccc2)nc2ccc(Cl)nc21.CC(C)(C)n1c(NC(=O)C[C@](C)(O)c2ccccc2)nc2ccc(Cl)nc21.CC(C)(O)c1ccc2nc(NC(=O)C[C@@](C)(O)c3ccccc3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(-c3ccc(OC(F)(F)F)cc3)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)O)n(-c3ccc(F)cc3)c2n1
• InChI: InChI=1S/C23H28N4O3.2C20H23ClN4O2.C20H21F3N4O2.C19H28N4O2.C18H19FN4O2/c1-22(2,29)18-13-12-17-20(25-18)27(16-10-7-11-16)21(24-17)26-19(28)14-23(3,30)15-8-5-4-6-9-15;2*1-19(2,3)25-17-14(10-11-15(21)23-17)22-18(25)24-16(26)12-20(4,27)13-8-6-5-7-9-13;1-12-5-10-15-17(24-12)27(18(25-15)26-16(28)11-19(2,3)4)13-6-8-14(9-7-13)29-20(21,22)23;1-18(2,3)11-15(24)22-17-20-13-9-10-14(19(4,5)25)21-16(13)23(17)12-7-6-8-12;1-11-4-9-14-16(20-11)23(13-7-5-12(19)6-8-13)17(21-14)22-15(24)10-18(2,3)25/h4-6,8-9,12-13,16,29-30H,7,10-11,14H2,1-3H3,(H,24,26,28);2*5-11,27H,12H2,1-4H3,(H,22,24,26);5-10H,11H2,1-4H3,(H,25,26,28);9-10,12,25H,6-8,11H2,1-5H3,(H,20,22,24);4-9,25H,10H2,1-3H3,(H,21,22,24)/t23-;2*20-;;;/m110.../s1
• InChIKey: UXOBNMDOZFPBKX-QUPMMNCMSA-N
• XLogP: 23.50
• TPSA: 489.47 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 31
• Rotatable Bonds: 26
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2275.51
LogP ≤ 5	23.50
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide?

The IUPAC name of (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide (CID 161221366) is (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide.

What is the SMILES notation for (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide?

The canonical SMILES for (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide is CC(C)(C)CC(=O)Nc1nc2ccc(C(C)(C)O)nc2n1C1CCC1.CC(C)(C)n1c(NC(=O)C[C@@](C)(O)c2ccccc2)nc2ccc(Cl)nc21.CC(C)(C)n1c(NC(=O)C[C@](C)(O)c2ccccc2)nc2ccc(Cl)nc21.CC(C)(O)c1ccc2nc(NC(=O)C[C@@](C)(O)c3ccccc3)n(C3CCC3)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)C)n(-c3ccc(OC(F)(F)F)cc3)c2n1.Cc1ccc2nc(NC(=O)CC(C)(C)O)n(-c3ccc(F)cc3)c2n1.

What is the InChIKey of (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide?

The InChIKey is UXOBNMDOZFPBKX-QUPMMNCMSA-N. The full InChI is InChI=1S/C23H28N4O3.2C20H23ClN4O2.C20H21F3N4O2.C19H28N4O2.C18H19FN4O2/c1-22(2,29)18-13-12-17-20(25-18)27(16-10-7-11-16)21(24-17)26-19(28)14-23(3,30)15-8-5-4-6-9-15;2*1-19(2,3)25-17-14(10-11-15(21)23-17)22-18(25)24-16(26)12-20(4,27)13-8-6-5-7-9-13;1-12-5-10-15-17(24-12)27(18(25-15)26-16(28)11-19(2,3)4)13-6-8-14(9-7-13)29-20(21,22)23;1-18(2,3)11-15(24)22-17-20-13-9-10-14(19(4,5)25)21-16(13)23(17)12-7-6-8-12;1-11-4-9-14-16(20-11)23(13-7-5-12(19)6-8-13)17(21-14)22-15(24)10-18(2,3)25/h4-6,8-9,12-13,16,29-30H,7,10-11,14H2,1-3H3,(H,24,26,28);2*5-11,27H,12H2,1-4H3,(H,22,24,26);5-10H,11H2,1-4H3,(H,25,26,28);9-10,12,25H,6-8,11H2,1-5H3,(H,20,22,24);4-9,25H,10H2,1-3H3,(H,21,22,24)/t23-;2*20-;;;/m110.../s1.

What are the key properties of (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide?

(3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide has a molecular weight of 2275.51 g/mol, XLogP of 23.50, 26 rotatable bonds, 12 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;(3S)-N-(3-tert-butyl-5-chloroimidazo[4,5-b]pyridin-2-yl)-3-hydroxy-3-phenylbutanamide;N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3,3-dimethylbutanamide;(3R)-N-[3-cyclobutyl-5-(2-hydroxypropan-2-yl)imidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-phenylbutanamide;3,3-dimethyl-N-[5-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[4,5-b]pyridin-2-yl]butanamide;N-[3-(4-fluorophenyl)-5-methylimidazo[4,5-b]pyridin-2-yl]-3-hydroxy-3-methylbutanamide is sourced from PubChem (CID 161221366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).